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SPARC is an accurate, efficient, and scalable real-space electronic structure code for performing ab initio Kohn-Sham density functional theory calculations. Version 2.0.0 of the software provides increased efficiency, and includes…

Graphics processing units (GPUs) are recently being used to an increasing degree for general computational purposes. This development is motivated by their theoretical peak performance, which significantly exceeds that of broadly available…

计算物理 · 物理学 2015-03-17 Martin Weigel

Scalable and efficient numerical simulations continue to gain importance, as computation is firmly established as the third pillar of discovery, alongside theory and experiment. Meanwhile, the performance of computing hardware grows through…

分布式、并行与集群计算 · 计算机科学 2019-06-26 Pietro Incardona , Antonio Leo , Yaroslav Zaluzhnyi , Rajesh Ramaswamy , Ivo F. Sbalzarini

Finding the maximum cut of a graph (MAXCUT) is a classic optimization problem that has motivated parallel algorithm development. While approximate algorithms to MAXCUT offer attractive theoretical guarantees and demonstrate compelling…

神经与进化计算 · 计算机科学 2022-10-07 Bradley H. Theilman , Yipu Wang , Ojas D. Parekh , William Severa , J. Darby Smith , James B. Aimone

Photonic computing offers a low-power, high-bandwidth paradigm for information processing; however, the analogue nature of conventional architectures means that intrinsic noise and fabrication imperfections greatly impact performance,…

We rewrite the metric/nonmetric and weighted/unweighted versions of the smacof program for square symmetric data as one monolithic C program. R is used for taking care of the data and parameter setup, the I/O, and of issuing a single call…

统计计算 · 统计学 2025-12-02 Jan de Leeuw

Multicore embedded systems have been constantly researched to improve the efficiency by changing certain metrics, such as processor, memory, cache hierarchies and their cache configurations. Using Multi2Sim and McPAT simulators in…

分布式、并行与集群计算 · 计算机科学 2016-01-14 Gorker Alp Malazgirt , Deniz Candas , Arda Yurdakul

GROMACS is a widely used package for biomolecular simulation, and over the last two decades it has evolved from small-scale efficiency to advanced heterogeneous acceleration and multi-level parallelism targeting some of the largest…

计算工程、金融与科学 · 计算机科学 2015-06-03 Páll Szilárd , Mark James Abraham , Carsten Kutzner , Berk Hess , Erik Lindahl

Recent advances in computing hardware and modeling software have given rise to new applications for numerical optimization. These new applications occasionally uncover bottlenecks in existing optimization algorithms and necessitate further…

数学软件 · 计算机科学 2024-10-18 Anugrah Jo Joshy , John T. Hwang

Neuromorphic systems open up opportunities to enlarge the explorative space for computational research. However, it is often challenging to unite efficiency and usability. This work presents the software aspects of this endeavor for the…

Energy-efficient real-time synapses and neurons are essential to enable large-scale neuromorphic computing. In this paper, we propose and demonstrate the Schottky-Barrier MOSFET-based ultra-low power voltage-controlled current source to…

This paper presents a method to automatically generate compact symbolic performance models of analog circuits with no prior specification of an equation template. The approach takes SPICE simulation data as input, which enables modeling of…

硬件体系结构 · 计算机科学 2011-11-09 Trent Mcconaghy , Tom Eeckelaert , Georges Gielen

The POSIX shell is a widely deployed, powerful tool for managing computer systems. The shell is the expert's control panel, a necessary tool for configuring, compiling, installing, maintaining, and deploying systems. Even though it is…

编程语言 · 计算机科学 2019-07-12 Michael Greenberg , Austin J. Blatt

We present version 4.0 of the symbolic manipulation system FORM. The most important new features are manipulation of rational polynomials and the factorization of expressions. Many other new functions and commands are also added; some of…

符号计算 · 计算机科学 2015-06-04 J. Kuipers , T. Ueda , J. A. M. Vermaseren , J. Vollinga

A model of computation that is widely used in the formal analysis of reactive systems is symbolic algorithms. In this model the access to the input graph is restricted to consist of symbolic operations, which are expensive in comparison to…

数据结构与算法 · 计算机科学 2017-11-28 Krishnendu Chatterjee , Wolfgang Dvořák , Monika Henzinger , Veronika Loitzenbauer

We present libsharp, a code library for spherical harmonic transforms (SHTs), which evolved from the libpsht library, addressing several of its shortcomings, such as adding MPI support for distributed memory systems and SHTs of fields with…

计算物理 · 物理学 2015-06-15 Martin Reinecke , Dag Sverre Seljebotn

Computing-in-memory (CIM) has attracted significant attentions in recent years due to its massive parallelism and low power consumption. However, current CIM designs suffer from large area overhead of small CIM macros and bad programmablity…

硬件体系结构 · 计算机科学 2022-05-04 Shu-Hung Kuo , Tian-Sheuan Chang

Recent developments in the interfacing of neurons with silicon chips may pave the way for progress in constructing scalable neurocomputers. The assembly of synthetic neuronal networks with predefined synaptic connections and controlled…

神经元与认知 · 定量生物学 2009-01-16 Nikesh S. Dattani

Purpose: Conventional MRI is relying on the assumption of the magnetic field being homogeneous in direction and amplitude. However, with the growing interest in portable, affordable point-of-care MRI systems, these assumptions do not…

医学物理 · 物理学 2026-02-17 Fabian Bschorr , Thomas Hüfken , Tobias Lobmeyer , Volker Rasche

We report our design, development, installation and troubleshooting of an open source Gnome X Scanning Microscopy (GXSM) software package for controlling and processing of modern Scanning Probe Microscopy (SPM) system as a development tool…

仪器与探测器 · 物理学 2014-10-13 S. K. Suresh Babu , J. S. Devrenjith Singh , D. Jackuline Moni , D. Devaprakasam